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Thieno[2,3-c]pyridine-3-carbonitrile,2-amino-4,5,6,7-tetrahydro-6-methyl-

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Name

Thieno[2,3-c]pyridine-3-carbonitrile,2-amino-4,5,6,7-tetrahydro-6-methyl-

EINECS N/A
CAS No. 37578-06-6 Density 1.32 g/cm3
PSA N/A LogP N/A
Solubility N/A Melting Point 192 °C
Formula C9H11N3S Boiling Point 392.4 °C at 760 mmHg
Molecular Weight 193.272 Flash Point 191.1 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 20/21/22-36/37/38
Molecular Structure Molecular Structure of 37578-06-6 (2-AMINO-6-METHYL-4,5,6,7-TETRAHYDROTHIENO[2,3-C]PYRIDINE-3-CARBONITRILE) Hazard Symbols CorrosiveC; IrritantXi
Synonyms

2-Amino-3-cyano-4,5,6,7-tetrahydro-6-methylthieno[2,3-c]piridine;NSC 99346;2-amino-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile;Thieno[2,3-c]pyridine-3-carbonitrile, 2-amino-4,5,6,7-tetrahydro-6-methyl-;2-amino-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile;

Article Data 5

Thieno[2,3-c]pyridine-3-carbonitrile,2-amino-4,5,6,7-tetrahydro-6-methyl- Specification

The Thieno[2,3-c]pyridine-3-carbonitrile,2-amino-4,5,6,7-tetrahydro-6-methyl-, with the CAS registry number 37578-06-6, has the systematic name of 2-amino-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile. And the molecular formula of the chemical is C9H11N3S.

The characteristics of Thieno[2,3-c]pyridine-3-carbonitrile,2-amino-4,5,6,7-tetrahydro-6-methyl- are as followings: (1)ACD/LogP: 0.93; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 58.51 Å2; (7)Index of Refraction: 1.65; (8)Molar Refractivity: 53.42 cm3; (9)Molar Volume: 146.3 cm3; (10)Polarizability: 21.18×10-24cm3; (11)Surface Tension: 67.4 dyne/cm; (12)Density: 1.32 g/cm3; (13)Flash Point: 191.1 °C; (14)Enthalpy of Vaporization: 64.21 kJ/mol; (15)Boiling Point: 392.4 °C at 760 mmHg; (16)Vapour Pressure: 2.3E-06 mmHg at 25°C.   

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin, and it is also harmful by inhalation, in contact with skin and if swallowed. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: N#Cc1c2c(sc1N)CN(CC2)C
(2)InChI: InChI=1/C9H11N3S/c1-12-3-2-6-7(4-10)9(11)13-8(6)5-12/h2-3,5,11H2,1H3
(3)InChIKey: WVPOJZUKIIRHOQ-UHFFFAOYAT

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